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1000340-80-6 | 1H-Pyrrolo[2,3-b]pyridin-4-amine, 6-chloro-
CAS No: 1000340-80-6 Catalog No: AG0000FI MDL No:MFCD09880161
Product Description
Catalog Number:
AG0000FI
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-4-amine, 6-chloro-
CAS Number:
1000340-80-6
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD09880161
IUPAC Name:
6-chloro-1H-pyrrolo[2,3-b]pyridin-4-amine
InChI:
InChI=1S/C7H6ClN3/c8-6-3-5(9)4-1-2-10-7(4)11-6/h1-3H,(H3,9,10,11)
InChI Key:
IKFOABTXBHOTPL-UHFFFAOYSA-N
SMILES:
Clc1cc(N)c2c(n1)[nH]cc2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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